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Substance Name: 1,3-Propanediol, 2-((4-allyl-2-methoxyphenoxy)methyl)-2-(hydroxymethyl)-
RN: 101101-44-4
InChIKey: JPVMLKAKVMSLKV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H22-O5

Molecular Weight

  • 282.3338
 
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Names and Synonyms

Synonyms

  • 2-((4-Allyl-2-methoxyphenoxy)methyl)-2-(hydroxymethyl)-1,3-propanediol
  • BRN 2534145

Systematic Name

  • 1,3-Propanediol, 2-((4-allyl-2-methoxyphenoxy)methyl)-2-(hydroxymethyl)-

Registry Numbers

CAS Registry Number

  • 101101-44-4

System Generated Number

  • 0101101444

Structure Descriptors

InChI

1S/C15H22O5/c1-3-4-12-5-6-13(14(7-12)19-2)20-11-15(8-16,9-17)10-18/h3,5-7,16-18H,1,4,8-11H2,2H3

InChIKey

JPVMLKAKVMSLKV-UHFFFAOYSA-N

Smiles

COc1cc(ccc1OCC(CO)(CO)CO)CC=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 718mg/kg (718mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Dissertationes Pharmaceuticae. Vol. 11, Pg. 223, 1959.